Cas no 52414-99-0 (1-iodo-3-methyl-2-nitrobenzene)

1-iodo-3-methyl-2-nitrobenzene structure
52414-99-0 structure
Product Name:1-iodo-3-methyl-2-nitrobenzene
CAS No:52414-99-0
MF:C7H6INO2
MW:263.032514095306
MDL:MFCD18398068
CID:1581103
PubChem ID:53338771
Update Time:2025-04-21

1-iodo-3-methyl-2-nitrobenzene Chemical and Physical Properties

Names and Identifiers

    • 1-Iodo-3-methyl-2-nitrobenzene
    • QC-8286
    • AB1008065
    • 3-Methyl-2-nitro-1-iodobenzene
    • 3-Iodo-2-nitrotoluene
    • 3-Iodo-2-nitro-toluene
    • DTXSID10693487
    • 3-Iodo-2-nitro toluene
    • iodonitrotoluene
    • MFCD18398068
    • AMY15025
    • AKOS015951121
    • iodonitrotoluol
    • YUHQOZRCAFHTGP-UHFFFAOYSA-N
    • AS-41690
    • SCHEMBL10696870
    • CS-0453244
    • CCA41499
    • 52414-99-0
    • 1-iodo-3-methyl-2-nitrobenzene
    • MDL: MFCD18398068
    • Inchi: 1S/C7H6INO2/c1-5-3-2-4-6(8)7(5)9(10)11/h2-4H,1H3
    • InChI Key: YUHQOZRCAFHTGP-UHFFFAOYSA-N
    • SMILES: IC1=CC=CC(C)=C1[N+](=O)[O-]

Computed Properties

  • Exact Mass: 262.94433g/mol
  • Monoisotopic Mass: 262.94433g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 157
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.2
  • Topological Polar Surface Area: 45.8?2

1-iodo-3-methyl-2-nitrobenzene Pricemore >>

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abcr
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